1-(4-methylphenyl)-2-oxopyrrolidine-3-carbonitrile


Chemical Name: 1-(4-methylphenyl)-2-oxopyrrolidine-3-carbonitrile
CAS Number: 930298-97-8
Product Number: AG00IHGH(AGN-PC-00TT2P)
Synonyms:
MDL No:
Molecular Formula: C12H12N2O
Molecular Weight: 200.2365

Identification/Properties


Computed Properties
Molecular Weight:
200.241g/mol
XLogP3:
1.7
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
1
Exact Mass:
200.095g/mol
Monoisotopic Mass:
200.095g/mol
Topological Polar Surface Area:
44.1A^2
Heavy Atom Count:
15
Formal Charge:
0
Complexity:
296
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
N/A
Signal Word:
UN#:
-
Hazard Statements:
-
Precautionary Statements:
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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